SCHEMBL29648441

SCHEMBL29648441

Brc1ccc(Nc2ccccc2-c2ccccc2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FABP3 P05413 1/20 0.47
FABP4 P15090 1/20 0.47
FABP5 Q01469 1/20 0.47
ALDH1A1 P00352 6/20 0.46
MAPK1 P28482 3/20 0.46
ABCG2 Q9UNQ0 1/20 0.44
MAPK13 O15264 1/20 0.43
MAPK12 P53778 1/20 0.43
MAPK11 Q15759 1/20 0.43
MAPK14 Q16539 1/20 0.43
NAT1 P18440 1/20 0.43
AURKA O14965 1/20 0.42
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
MAPT P10636 4/20 0.41
KDM4E B2RXH2 2/20 0.41
GAA P10253 2/20 0.41
TDP1 Q9NUW8 2/20 0.41
GLA P06280 1/20 0.41
RECQL P46063 1/20 0.41

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL15987640 1.00 FABP3 (0.47) FABP3FABP4FABP5ALDH1A1MAPK1
SCHEMBL16694267 0.92 ALDH1A1 (0.46) FABP3FABP4FABP5ALDH1A1MAPK1
SCHEMBL27686533 0.92 ALDH1A1 (0.46) FABP3FABP4FABP5ALDH1A1MAPK1
SCHEMBL4428807 0.86 FABP3 (0.52) FABP3FABP4FABP5ALDH1A1MAPK1
SCHEMBL5365481 0.86 FABP3 (0.52) FABP3FABP4FABP5ALDH1A1MAPK1
SCHEMBL24057710 0.86 FABP3 (0.52) FABP3FABP4FABP5ALDH1A1MAPK1
SCHEMBL15549870 0.86 FABP3 (0.52) FABP3FABP4FABP5ALDH1A1MAPK1
SCHEMBL17733473 0.86 FABP3 (0.52) FABP3FABP4FABP5ALDH1A1MAPK1
SCHEMBL23111305 0.86 FABP3 (0.52) FABP3FABP4FABP5ALDH1A1MAPK1
SCHEMBL5457659 0.86 FABP3 (0.52) FABP3FABP4FABP5ALDH1A1MAPK1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114605314-B Indene derivative and application thereof 上海八亿时空先进材料有限公司 2024-04-02 CN disclosed
CN-117327109-A Light emitting device and polycyclic compound for use therein 三星显示有限公司 2024-01-02 CN disclosed
CN-117143123-A Light emitting device and condensed polycyclic compound for the same 三星显示有限公司 2023-12-01 CN disclosed
CN-112442046-B Naphthalene bridged carbazole derivative and application thereof 北京八亿时空液晶科技股份有限公司 2023-04-28 CN disclosed
CN-114605314-A Indene derivative and application thereof 上海八亿时空先进材料有限公司 2022-06-10 CN disclosed